SCHEMBL5188643

SCHEMBL5188643

O=C1N=NC(=O)c2cc(O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.56
ESR2 Q92731 11/20 0.56
MAOA P21397 2/20 0.56
MAOB P27338 2/20 0.56
UGT1A1 P22309 1/20 0.56
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
PBRM1 Q86U86 1/20 0.42
TTR P02766 1/20 0.41
PTPRC P08575 1/20 0.41
USP7 Q93009 1/20 0.41
USP47 Q96K76 1/20 0.41
PRKCI P41743 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6773808 0.76 S100A4 (0.56) ESR1ESR2CA1CA2CA7
SCHEMBL18786963 0.74 ESR2 (0.48) ESR1ESR2MAOAMAOBUGT1A1
SCHEMBL30410371 0.72 ESR2 (0.90) ESR1ESR2MAOAMAOBUGT1A1
Anthraflavicacid SCHEMBL31105422 0.72 ESR2 (1.00) ESR1ESR2MAOAMAOBUGT1A1
Anthraflavicacid SCHEMBL124974 0.72 ESR2 (1.00) ESR1ESR2MAOAMAOBUGT1A1
SCHEMBL23111390 0.72 ESR2 (0.80) ESR1ESR2MAOAMAOBUGT1A1
SCHEMBL29486239 0.72 ESR2 (0.90) ESR1ESR2MAOAMAOBUGT1A1
SCHEMBL539276 0.72 ESR2 (0.90) ESR1ESR2MAOAMAOBUGT1A1
Anthraflavicacid SCHEMBL29985684 0.72 ESR2 (1.00) ESR1ESR2MAOAMAOBUGT1A1
SCHEMBL2772476 0.72 ESR2 (1.00) ESR1ESR2MAOAMAOBUGT1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015641-B1 SIMPLIFIED SEQUENTIAL CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 2007-06-13 EP disclosed
EP-1015641-A4 SIMPLIFIED SEQUENTIAL CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 2003-04-16 EP disclosed
EP-0938677-A4 CHEMILUMINESCENT DETECTION METHODS USING DUAL ENZYME-LABELED BINDING PARTNERS LUMIGEN INC (US) 2000-09-27 EP disclosed
EP-1015641-A1 SIMPLIFIED SEQUENTIAL CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 2000-07-05 EP disclosed
US-6068979-A IMMOBILIZING TARGETS, CONTACTING WITH LABELED SPECIFIC BINDING PARTNERS FOR EACH TARGET, REACTING WITH SUBSTRATE FOR FIRST LABEL, DETECTING, REACTING WITH SUBSTRATE FOR SECOND ENZYME, DETECTING; ELIMINATES NEED FOR STRIPPING/REPROBING LUMIGEN, INC. (US) 2000-05-30 US disclosed
WO-1999054503-A1 SIMPLIFIED SEQUENTIAL CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1999-10-28 WO disclosed
EP-0938677-A1 CHEMILUMINESCENT DETECTION METHODS USING DUAL ENZYME-LABELED BINDING PARTNERS LUMIGEN, INC. (US) 1999-09-01 EP disclosed
US-5843666-A Chemiluminescent detection methods using dual enzyer-labeled binding partners LUMIGEN, INC. (US) 1998-12-01 US disclosed
WO-1998021586-A1 CHEMILUMINESCENT DETECTION METHODS USING DUAL ENZYME-LABELED BINDING PARTNERS LUMIGEN, INC. (US) 1998-05-22 WO disclosed